(2E)-3-[(6-acetyl-1,3-benzodioxol-5-yl)amino]-2-(4-phenyl-1,3-thiazol-2-yl)-2-propenenitrile

SpectraBase Compound ID	D5sWvP52sjj
InChI	InChI=1S/C21H15N3O3S/c1-13(25)16-7-19-20(27-12-26-19)8-17(16)23-10-15(9-22)21-24-18(11-28-21)14-5-3-2-4-6-14/h2-8,10-11,23H,12H2,1H3/b15-10+
InChIKey	XCTJQQZRTPPKMM-XNTDXEJSSA-N Google Search
Mol Weight	389.43 g/mol
Molecular Formula	C21H15N3O3S
Exact Mass	389.083413 g/mol

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SpectraBase Spectrum ID	AofMwRwlUlb
Name	(2E)-3-[(6-acetyl-1,3-benzodioxol-5-yl)amino]-2-(4-phenyl-1,3-thiazol-2-yl)-2-propenenitrile
Author	A.V.Yarkov, IPAC, Russia
Copyright	Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI	InChI=1S/C21H15N3O3S/c1-13(25)16-7-19-20(27-12-26-19)8-17(16)23-10-15(9-22)21-24-18(11-28-21)14-5-3-2-4-6-14/h2-8,10-11,23H,12H2,1H3/b15-10+
InChIKey	XCTJQQZRTPPKMM-XNTDXEJSSA-N
NMR Offset	15.328
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_UBI-VK_18310_4444
Owner	Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State	soluted
Solvent	DMSO-d6
Source File Reference	VendorID: 120451; Labnumber: ULGAP-01-5374; VK_ID: VK-004445
Synonyms	3-[(6-acetyl-1,3-benzodioxol-5-yl)amino]-2-(4-phenyl-1,3-thiazol-2-yl)-2-propenenitrile
Temperature	318 °C